Presentation Information

[D341-2vn-03]Integration of Quantum Chemical Calculation and Molecular Dynamics Simulation: A Novel Approach for the Organometallic-Catalyzed Thermosetting Polymers

○YUKUN BAI1, Naoki Kishimoto1, gota kikugawa2 (1. Graduate School of Science, Tohoku University, 2. Institute of Fluid Science, Tohoku University)
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Keywords:

Quantum Chemistry Calculation,Molecular Dynamics Simulation,Thermosetting Polymer,Cyanate Resin